Vitas-M small molecule compound
(2E)-1-[4-(5,7-diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-3-(3-methoxyphenyl)prop-2-en-1-one
Catalog ID
STK875451
SMILES COc1cccc(c1)/C=C/C(=O)N1CCN(CC1)c1ncnc2c1c(cn2c1ccccc1)c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C32H29N5O2 MW 515.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N5O2/c1-39-27-14-8-9-24(21-27)15-16-29(38)35-17-19-36(20-18-35)31-30-28(25-10-4-2-5-11-25)22-37(32(30)34-23-33-31)26-12-6-3-7-13-26/h2-16,21-23H,17-20H2,1H3/b16-15+InChIKey
DTQJMUWWWVGBCL-FOCLMDBBSA-NSynonyms
(2E)1(4(57diphenyl7Hpyrrolo(23d)pyrimidin4yl)piperazin1yl)3(3methoxyphenyl)prop2en1one
(2E)1(4(57DIPHENYLPYRROLO(32E)PYRIMIDIN4YL)PIPERAZINYL)3(3METHOXYPHENYL)PROP2EN1ONE
(E)1(4(57diphenylpyrrolo(23d)pyrimidin4yl)piperazin1yl)3(3methoxyphenyl)prop2en1one
COC1=CC=CC(=C1)C=CC(=O)N2CCN(CC2)C3=NC=NC4=C3C(=CN4C5=CC=CC=C5)C6=CC=CC=C6
COc1cccc(c1)C=CC(=O)N1CCN(CC1)c1ncnc2c1c(cn2c1ccccc1)c1ccccc1
InChI=1SC32H29N5O2c13927148924(2127)151629(38)35171936(201835)313028(25104251125)2237(32(30)34233331)26126371326h2162123H1720H21H3b1615+
MFCD09762627
ZINC000021525746
ZINC21525746
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